Geometry & MOs

Info

ID:	212827
PubChem CID:	81061915
Reduced:	NSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	199.168462
ΔH_f, kcal/mol:	-106.51
Dipole, Da:	4.28
IP(EA), eV:	-9.47(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-2-methyl-3-[methyl(2-propan-2-yloxyethyl)amino]propanenitrile

Drug info:

PubChemData

Smile

CCOCCN(C)S(=O)(=O)C1=CC=C(C=C1)C#CCO

DOS

IR

Vibrations